2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine

Systemtic Name: 2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine Openeye Name: 2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine CAS Name: 2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine IUPAC Name: 2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine Traditional Name: 2-(4-decoxyphenyl)-5-(4-methyl-5-octyl-1,3-dioxan-2-yl)pyrimidine Formula: C33H52N2O3 MolecularWeight: 524.77758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3OCC(C(O3)C)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3OCC(C(O3)C)CCCCCCCC

InChI

InChI=1S/C33H52N2O3/c1-4-6-8-10-12-13-15-17-23-36-31-21-19-28(20-22-31)32-34-24-30(25-35-32)33-37-26-29(27(3)38-33)18-16-14-11-9-7-5-2/h19-22,24-25,27,29,33H,4-18,23,26H2,1-3H3